1-[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]-3-(4-nitrophenyl)thiourea

Systemtic Name: 1-[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]-3-(4-nitrophenyl)thiourea Openeye Name: 1-(4-indolin-1-ylsulfonylphenyl)-3-(4-nitrophenyl)thiourea CAS Name: 1-[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]-3-(4-nitrophenyl)thiourea IUPAC Name: 1-[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]-3-(4-nitrophenyl)thiourea Traditional Name: 1-(4-indolin-1-ylsulfonylphenyl)-3-(4-nitrophenyl)thiourea Formula: C21H18N4O4S2 MolecularWeight: 454.52202

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)NC(=S)NC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(C2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)NC(=S)NC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H18N4O4S2/c26-25(27)18-9-5-16(6-10-18)22-21(30)23-17-7-11-19(12-8-17)31(28,29)24-14-13-15-3-1-2-4-20(15)24/h1-12H,13-14H2,(H2,22,23,30)